Water → 1-Isopropyl-4-(5-nitro-pyridin-2-yl)-piperazine
반응식
[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][NH:7][CH2:8][CH2:9]1.[Cl:10][c:11]1[n:12][cH:13][c:14]([N+:17](=[O:18])[O-:19])[cH:15][cH:16]1.[Cl:20][CH2:21][Cl:22].[Cl:23][CH2:24][Cl:25].[OH2:26]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][N:7]([c:11]2[n:12][cH:13][c:14]([N+:17](=[O:18])[O-:19])[cH:15][cH:16]2)[CH2:8][CH2:9]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-dd9239eaafd54e13a393c6cca0d178f6
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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